Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | GLS2 | Q9UI32 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL15510969 | 1.00 | ACHE (0.38) | ACHEBACE1ALOX5PTGS2PTPN1 | |
| SCHEMBL7647125 | 1.00 | ACHE (0.38) | ACHEBACE1ALOX5PTGS2PTPN1 | |
| SCHEMBL27884483 | 1.00 | ACHE (0.38) | ACHEBACE1ALOX5PTGS2PTPN1 | |
| SCHEMBL27901578 | 1.00 | ACHE (0.38) | ACHEBACE1ALOX5PTGS2PTPN1 | |
| SCHEMBL28508853 | 1.00 | ACHE (0.38) | ACHEBACE1ALOX5PTGS2PTPN1 | |
| SCHEMBL28044445 | 1.00 | ACHE (0.38) | ACHEBACE1ALOX5PTGS2PTPN1 | |
| SCHEMBL28598443 | 0.98 | ACHE (0.37) | ACHEBACE1ALOX5PTGS2PTPN1 | |
| SCHEMBL28301332 | 0.98 | ACHE (0.36) | ACHEBACE1 | |
| Ammonia Solution, Strong SCHEMBL28805016 | 0.97 | ACHE (0.35) | ACHEBACE1 | |
| SCHEMBL27529149 | 0.97 | ACHE (0.35) | ACHEBACE1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103097390-B | β functionalization dihydroxy chlorin is used for the application of PDT | 拜欧利泰克投资二代公司 | 2017-03-08 | — | — | CN | disclosed |
| CN-103097390-A | Application of beta-functionalized dihydroxy-chlorins for PDT | CERAMOPTEC GMBH | 2013-05-08 | — | — | CN | disclosed |